(2-bromanyl-4-cyano-6-ethoxy-phenyl) naphthalene-2-sulfonate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) naphthalene-2-sulfonate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C19H14BrNO4S MolecularWeight: 432.28776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H14BrNO4S/c1-2-24-18-10-13(12-21)9-17(20)19(18)25-26(22,23)16-8-7-14-5-3-4-6-15(14)11-16/h3-11H,2H2,1H3